5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine

C12H22N4OS — CID 94696966

IUPAC5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
SMILESCc1nc(NCCN2CCOCC2)sc1CCN
InChIInChI=1S/C12H22N4OS/c1-10-11(2-3-13)18-12(15-10)14-4-5-16-6-8-17-9-7-16/h2-9,13H2,1H3,(H,14,15)
InChIKeyLGHWXNPFMTYRKW-UHFFFAOYSA-N
MW270.40 g/mol
LogP0.70
Rot. Bonds6

About 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine

5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine (PubChem CID 94696966) has the molecular formula C12H22N4OS and a molecular weight of 270.40 g/mol. Its IUPAC name is 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
PubChem CID94696966
Molecular FormulaC12H22N4OS
Molecular Weight270.40 g/mol
Exact Mass270.15
IUPAC Name5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
SMILESCc1nc(NCCN2CCOCC2)sc1CCN
InChIInChI=1S/C12H22N4OS/c1-10-11(2-3-13)18-12(15-10)14-4-5-16-6-8-17-9-7-16/h2-9,13H2,1H3,(H,14,15)
InChIKeyLGHWXNPFMTYRKW-UHFFFAOYSA-N
XLogP0.70
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-2-(3-morpholin-4-ylpropylamino)-1,3-thiazole-5-carboxylic acid
CID 80570559
ethane;5-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
CID 143962241
4-methoxy-5,7-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-benzothiazol-2-amine
CID 82548601
4,5-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65169595
3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-oxadiazol-5-amine
CID 59058894
3-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine
CID 133352124
2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 77078700
5-(2-morpholin-4-ylethylamino)-3H-1,3,4-thiadiazole-2-thione
CID 16767731
N-[4-methyl-5-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]acetamide
CID 1338962
2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine
CID 82427748
5-chloro-4-(4-methylphenyl)sulfonyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;hydrochloride
CID 45099975
4-methylsulfonyl-N-(2-morpholin-4-ylethyl)-1,3-benzothiazol-2-amine
CID 45496623

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine (CID 94696966) is 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine is Cc1nc(NCCN2CCOCC2)sc1CCN.
What is the InChIKey of 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
The InChIKey is LGHWXNPFMTYRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4OS/c1-10-11(2-3-13)18-12(15-10)14-4-5-16-6-8-17-9-7-16/h2-9,13H2,1H3,(H,14,15).
What are the key properties of 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine has a molecular weight of 270.40 g/mol, XLogP of 0.70, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-4-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 94696966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).